1-(3-cyclobutylpropyl)-3,5-dimethylpyrazol-4-amine

C12H21N3 — CID 165472719

IUPAC1-(3-cyclobutylpropyl)-3,5-dimethylpyrazol-4-amine
SMILESCc1nn(CCCC2CCC2)c(C)c1N
InChIInChI=1S/C12H21N3/c1-9-12(13)10(2)15(14-9)8-4-7-11-5-3-6-11/h11H,3-8,13H2,1-2H3
InChIKeyUAYHCZZYTOPBPI-UHFFFAOYSA-N
MW207.32 g/mol
LogP2.66
Rot. Bonds4

About 1-(3-cyclobutylpropyl)-3,5-dimethylpyrazol-4-amine

1-(3-cyclobutylpropyl)-3,5-dimethylpyrazol-4-amine (PubChem CID 165472719) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is 1-(3-cyclobutylpropyl)-3,5-dimethylpyrazol-4-amine.

Molecular Properties

Compound Name1-(3-cyclobutylpropyl)-3,5-dimethylpyrazol-4-amine
PubChem CID165472719
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC Name1-(3-cyclobutylpropyl)-3,5-dimethylpyrazol-4-amine
SMILESCc1nn(CCCC2CCC2)c(C)c1N
InChIInChI=1S/C12H21N3/c1-9-12(13)10(2)15(14-9)8-4-7-11-5-3-6-11/h11H,3-8,13H2,1-2H3
InChIKeyUAYHCZZYTOPBPI-UHFFFAOYSA-N
XLogP2.66
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(3-cyclobutylpropyl)-3,5-dimethylpyrazol-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(3-cyclobutylpropyl)-3,5-dimethylpyrazol-4-amine?
The IUPAC name of 1-(3-cyclobutylpropyl)-3,5-dimethylpyrazol-4-amine (CID 165472719) is 1-(3-cyclobutylpropyl)-3,5-dimethylpyrazol-4-amine.
What is the SMILES notation for 1-(3-cyclobutylpropyl)-3,5-dimethylpyrazol-4-amine?
The canonical SMILES for 1-(3-cyclobutylpropyl)-3,5-dimethylpyrazol-4-amine is Cc1nn(CCCC2CCC2)c(C)c1N.
What is the InChIKey of 1-(3-cyclobutylpropyl)-3,5-dimethylpyrazol-4-amine?
The InChIKey is UAYHCZZYTOPBPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3/c1-9-12(13)10(2)15(14-9)8-4-7-11-5-3-6-11/h11H,3-8,13H2,1-2H3.
What are the key properties of 1-(3-cyclobutylpropyl)-3,5-dimethylpyrazol-4-amine?
1-(3-cyclobutylpropyl)-3,5-dimethylpyrazol-4-amine has a molecular weight of 207.32 g/mol, XLogP of 2.66, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-cyclobutylpropyl)-3,5-dimethylpyrazol-4-amine is sourced from PubChem (CID 165472719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).